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cis-2-Pentadecyl-1,3-dioxane-4-phosphoric acid
SpectraBase Compound ID L2JqXgKGhKN
InChI InChI=1S/C19H39O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-23-17-16-19(24-18)25-26(20,21)22/h18-19H,2-17H2,1H3,(H2,20,21,22)/t18-,19+/m0/s1
InChIKey QTFIZIXTZIKUBC-RBUKOAKNSA-N
Mol Weight 394.5 g/mol
Molecular Formula C19H39O6P
Exact Mass 394.248426 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KO0bnckI2ud
Name cis-2-Pentadecyl-1,3-dioxane-4-phosphoric acid
Alternate Name(s) (2S,4R)-2-pentadecyl-1,3-dioxan-4-yl dihydrogen phosphate
CAS Registry Number 73116-85-5
Comments Less than 3 mono-isotopic peaks
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Formula C19H39O6P
InChI InChI=1S/C19H39O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-23-17-16-19(24-18)25-26(20,21)22/h18-19H,2-17H2,1H3,(H2,20,21,22)/t18-,19+/m0/s1
InChIKey QTFIZIXTZIKUBC-RBUKOAKNSA-N
Molecular Weight 394.489 g/mol
SMILES OP(O[C@]1(O[C@@](CCCCCCCCCCCCCCC)(OCC1)[H])[H])(=O)O
SPLASH splash10-0udi-0900000000-7b1196ce2ce29f844f8e
Source of Spectrum J-45-1585-0
Wiley ID 1366548